3-[[1-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)butyl-cyclohexyl-amino]methyl]-6,8-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[[1-(1-tert-butyl-1,2,3,4-tetrazol-5-yl)butyl-cyclohexyl-amino]methyl]-6,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[[1-(1-tert-butyltetrazol-5-yl)butyl-cyclohexyl-amino]methyl]-6,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[[1-(1-tert-butyl-5-tetrazolyl)butyl-cyclohexylamino]methyl]-6,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[[1-(1-tert-butyltetrazol-5-yl)butyl-cyclohexylamino]methyl]-6,8-dimethyl-1H-quinolin-2-one Traditional Name: 3-[[1-(1-tert-butyltetrazol-5-yl)butyl-cyclohexyl-amino]methyl]-6,8-dimethyl-carbostyril Formula: C27H40N6O MolecularWeight: 464.6461

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NN=NN1C(C)(C)C)N(CC2=CC3=CC(=CC(=C3NC2=O)C)C)C4CCCCC4

Isomeric SMILES

CCCC(C1=NN=NN1C(C)(C)C)N(CC2=CC3=CC(=CC(=C3NC2=O)C)C)C4CCCCC4

InChI

InChI=1S/C27H40N6O/c1-7-11-23(25-29-30-31-33(25)27(4,5)6)32(22-12-9-8-10-13-22)17-21-16-20-15-18(2)14-19(3)24(20)28-26(21)34/h14-16,22-23H,7-13,17H2,1-6H3,(H,28,34)